| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 18 | Yes |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.24 | 5.87 | -88.21 | 4 | 3 | 2 | 35 | 249.402 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.24 | 3.9 | -45.21 | 3 | 3 | 1 | 34 | 248.394 | 4 | ↓ |
Popular Name: N-isobutyl-N',N'-dimethyl-N-[4-(methylaminomethyl)phenyl]ethane-1,2-diamine N-isobutyl-N',N'-dimethyl-N-[4-(…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.75 | 9.06 | -83.28 | 3 | 3 | 2 | 24 | 265.445 | 8 | ↓ |
| Hi High (pH 8-9.5) | 2.75 | 6.58 | -36.33 | 2 | 3 | 1 | 23 | 264.437 | 8 | ↓ |
